3-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-6,7-dimethoxy-3H-2-benzofuran-1-one

Systemtic Name: 3-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-6,7-dimethoxy-3H-2-benzofuran-1-one Openeye Name: 3-[2-(4-bromophenyl)-2-oxo-ethyl]-6,7-dimethoxy-3H-isobenzofuran-1-one CAS Name: 3-[2-(4-bromophenyl)-2-oxoethyl]-6,7-dimethoxy-3H-isobenzofuran-1-one IUPAC Name: 3-[2-(4-bromophenyl)-2-oxoethyl]-6,7-dimethoxy-3H-2-benzofuran-1-one Traditional Name: 3-[2-(4-bromophenyl)-2-keto-ethyl]-6,7-dimethoxy-phthalide Formula: C18H15BrO5 MolecularWeight: 391.2127

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)CC(=O)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)CC(=O)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C18H15BrO5/c1-22-14-8-7-12-15(24-18(21)16(12)17(14)23-2)9-13(20)10-3-5-11(19)6-4-10/h3-8,15H,9H2,1-2H3